Quimat - Cheminformatics and Materials (Quimat)
AuthID: I-000-BCW
Publications Actions
Publications at Authenticus Institutional Profile
An Authenticus institution (group) is an organization which consists of a set of researchers (institutional/group team). The set of researchers depends on the organizational structure of the institution per year and can be set at the institution profile, under ‘Researchers’ interface. Based on the institutional team we produce listings of publications, statistics and institutional reports.
Publications displayed at an Authenticus institutional profile depend on two parameters:
- Researchers team associated with the institution per year.
- Publications source type.
We define 3 types of publication sources:
- Validated by team members - includes all publications validated by team members. Requires the definition of the institutional team.
- All published by team members - includes all publications validated by the institution team members plus all not-validated (only identified) publications. Requires the definition of the institutional team.
- Affiliation Based - includes publications that have the institution/group in the publication affiliation. Does not require institutional team, but at the same time does not guarantee that all publications will be listed.
External
Internal
No data about last update.
Rules:
This actions updates publications citations of every team member.
Only validated by team members publications are included.
Only the current year team is included in this action.>
The action is executed in the background, thus the results are NOT immediate.
This actions can be executed only once a month!
Only validated by team members publications are included.
Only the current year team is included in this action.>
The action is executed in the background, thus the results are NOT immediate.
This actions can be executed only once a month!
No data about last update.
Rules:
This actions updates all pre print publications of the group/institution.
Only validated by current year team members publications are included.
The action is executed in the background, thus the results are NOT immediate.
This actions can be executed only once a day!
Only validated by current year team members publications are included.
The action is executed in the background, thus the results are NOT immediate.
This actions can be executed only once a day!
Publications Count: 646
15 Team MembersFilters -> Year: 2026
81
TITLE: In silico characterization of aryl benzoyl hydrazide derivatives as potential inhibitors of RdRp enzyme of H5N1 influenza virus Full Text
AUTHORS: Ghosh, Abhishek; Panda, Parthasarathi; Halder, Amit Kumar ; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: FRONTIERS IN PHARMACOLOGY, VOLUME: 13
AUTHORS: Ghosh, Abhishek; Panda, Parthasarathi; Halder, Amit Kumar ; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: FRONTIERS IN PHARMACOLOGY, VOLUME: 13
82
TITLE: Insights into the Mechanism of Methanol Steam Reforming for Hydrogen Production over Ni-Cu-Based Catalysts
AUTHORS: Fajin, JLC ; Cordeiro, MNDS ;
PUBLISHED: 2022, SOURCE: ACS CATALYSIS, VOLUME: 12, ISSUE: 1, PAGES: 512-526
AUTHORS: Fajin, JLC ; Cordeiro, MNDS ;
PUBLISHED: 2022, SOURCE: ACS CATALYSIS, VOLUME: 12, ISSUE: 1, PAGES: 512-526
83
TITLE: Legislators' Plague. How History of Science Can Explain the Struggles of Universal Pandemic Responses
AUTHORS: José Ferraz-Caetano ; Bruno D A Pinheiro ;
PUBLISHED: 2022, SOURCE: Handbook of Research on Historical Pandemic Analysis and the Social Implications of COVID-19 - Advances in Human Services and Public Health, PAGES: 47-59
AUTHORS: José Ferraz-Caetano ; Bruno D A Pinheiro ;
PUBLISHED: 2022, SOURCE: Handbook of Research on Historical Pandemic Analysis and the Social Implications of COVID-19 - Advances in Human Services and Public Health, PAGES: 47-59
INDEXED IN: 
CrossRef
CrossRef84
TITLE: Long-range communication between transmembrane- and nucleotide-binding domains does not depend on drug binding to mutant P-glycoprotein
AUTHORS: Cátia A Bonito; Ricardo J Ferreira; Maria-José.U Ferreira; Jean-Pierre Gillet; Natália N D S Cordeiro ; Daniel J V A dos Santos ;
PUBLISHED: 2022
AUTHORS: Cátia A Bonito; Ricardo J Ferreira; Maria-José.U Ferreira; Jean-Pierre Gillet; Natália N D S Cordeiro ; Daniel J V A dos Santos ;
PUBLISHED: 2022
INDEXED IN: CrossRef
CrossRef85
TITLE: Moving Average-Based Multitasking In Silico Classification Modeling: Where Do We Stand and What Is Next? Full Text
AUTHORS: Halder, Amit Kumar ; Moura, Ana S. ; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, VOLUME: 23, ISSUE: 9, PAGES: 4937
AUTHORS: Halder, Amit Kumar ; Moura, Ana S. ; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, VOLUME: 23, ISSUE: 9, PAGES: 4937
86
TITLE: N2O Hydrogenation on Silver Doped Gold Catalysts, a DFT Study
AUTHORS: Fajin, Jose L. C. ; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: NANOMATERIALS, VOLUME: 12, ISSUE: 3, PAGES: 394
AUTHORS: Fajin, Jose L. C. ; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: NANOMATERIALS, VOLUME: 12, ISSUE: 3, PAGES: 394
87
TITLE: p A simple electrochemical detection of atorvastatin based on disposable screen-printed carbon electrodes modified by molecularly imprinted polymer: Experiment and simulation Full Text
AUTHORS: Rebelo, P; Pacheco, JG; Voroshylova, IV ; Melo, A ; Cordeiro, MNDS ; Delerue Matos, C ;
PUBLISHED: 2022, SOURCE: ANALYTICA CHIMICA ACTA, VOLUME: 1194, PAGES: 339410
AUTHORS: Rebelo, P; Pacheco, JG; Voroshylova, IV ; Melo, A ; Cordeiro, MNDS ; Delerue Matos, C ;
PUBLISHED: 2022, SOURCE: ANALYTICA CHIMICA ACTA, VOLUME: 1194, PAGES: 339410
88
TITLE: Predicting the Surface Tension of Deep Eutectic Solvents: A Step Forward in the Use of Greener Solvents Full Text
AUTHORS: Halder, Amit Kumar ; Haghbakhsh, Reza; Voroshylova, Iuliia V. ; Duarte, Ana Rita C.; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: MOLECULES, VOLUME: 27, ISSUE: 15, PAGES: 4896
AUTHORS: Halder, Amit Kumar ; Haghbakhsh, Reza; Voroshylova, Iuliia V. ; Duarte, Ana Rita C.; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: MOLECULES, VOLUME: 27, ISSUE: 15, PAGES: 4896
89
TITLE: Relating the Ambient Temperature and Ionic Liquid Structure to the Changes of Capacitance Using Molecular Dynamics
AUTHORS: Heigo Ers; Iuliia Voroshylova ; Piret Pikma; Vladislav Ivanistsev;
PUBLISHED: 2022, SOURCE: ECS Meeting Abstracts, VOLUME: MA2022-01, ISSUE: 46, PAGES: 1958-1958
AUTHORS: Heigo Ers; Iuliia Voroshylova ; Piret Pikma; Vladislav Ivanistsev;
PUBLISHED: 2022, SOURCE: ECS Meeting Abstracts, VOLUME: MA2022-01, ISSUE: 46, PAGES: 1958-1958
INDEXED IN: CrossRef
CrossRef90
TITLE: Synthesis, anticancer activity, SAR and binding mode of interaction studies of substituted pentanoic acids: part II
AUTHORS: Datta, S; Halder, AK ; Adhikari, N; Amin, SA; Das, S; Jha, T;
PUBLISHED: 2022, SOURCE: FUTURE MEDICINAL CHEMISTRY, VOLUME: 14, ISSUE: 1, PAGES: 17-34
AUTHORS: Datta, S; Halder, AK ; Adhikari, N; Amin, SA; Das, S; Jha, T;
PUBLISHED: 2022, SOURCE: FUTURE MEDICINAL CHEMISTRY, VOLUME: 14, ISSUE: 1, PAGES: 17-34
INDEXED IN: 
Scopus 
WOS
Scopus WOS91
TITLE: Theoretical Study on the Diels–Alder Reaction of Fullerenes: Analysis of Isomerism, Aromaticity, and Solvation
AUTHORS: Diogo J L Rodrigues; Luís M N B F Santos ; André Melo ; Carlos F R A C Lima ;
PUBLISHED: 2022, SOURCE: Organics, VOLUME: 3, ISSUE: 4, PAGES: 364-379
AUTHORS: Diogo J L Rodrigues; Luís M N B F Santos ; André Melo ; Carlos F R A C Lima ;
PUBLISHED: 2022, SOURCE: Organics, VOLUME: 3, ISSUE: 4, PAGES: 364-379
92
TITLE: Toxicity Assessment of the Binary Mixtures of Aquatic Organisms Based on Different Hypothetical Descriptors Full Text
AUTHORS: Ji, Meng; Zhang, Lihong; Zhuang, Xuming; Tian, Chunyuan; Luan, Feng; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: MOLECULES, VOLUME: 27, ISSUE: 19, PAGES: 6389
AUTHORS: Ji, Meng; Zhang, Lihong; Zhuang, Xuming; Tian, Chunyuan; Luan, Feng; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: MOLECULES, VOLUME: 27, ISSUE: 19, PAGES: 6389
93
TITLE: Turning deep-eutectic solvents into value-added products for CO2 capture: A desirability-based virtual screening study Full Text
AUTHORS: Ambure, Pravin ; Perez Castillo, Yunierkis; Halder, Amit Kumar; Cordeiro, M. Natalia D. S. ;
PUBLISHED: 2022, SOURCE: JOURNAL OF CO2 UTILIZATION, VOLUME: 58, PAGES: 101926
AUTHORS: Ambure, Pravin ; Perez Castillo, Yunierkis; Halder, Amit Kumar; Cordeiro, M. Natalia D. S. ;
PUBLISHED: 2022, SOURCE: JOURNAL OF CO2 UTILIZATION, VOLUME: 58, PAGES: 101926
94
TITLE: "Ethics against Chemistry": Solving a Crime Using Chemistry Concepts and Storytelling in a History of Science-Based Interactive Game for Middle School Students Full Text
AUTHORS: Dias, D; José Ferraz-Caetano ; Paiva, J ;
PUBLISHED: 2021, SOURCE: JOURNAL OF CHEMICAL EDUCATION, VOLUME: 98, ISSUE: 5, PAGES: 1681-1690
AUTHORS: Dias, D; José Ferraz-Caetano ; Paiva, J ;
PUBLISHED: 2021, SOURCE: JOURNAL OF CHEMICAL EDUCATION, VOLUME: 98, ISSUE: 5, PAGES: 1681-1690
95
TITLE: Advanced Materials Based on Nanosized Hydroxyapatite Full Text
AUTHORS: Ramón Rial; Michael González-Durruthy ; Zhen Liu; Juan M Ruso;
PUBLISHED: 2021, SOURCE: Molecules, VOLUME: 26, ISSUE: 11, PAGES: 3190
AUTHORS: Ramón Rial; Michael González-Durruthy ; Zhen Liu; Juan M Ruso;
PUBLISHED: 2021, SOURCE: Molecules, VOLUME: 26, ISSUE: 11, PAGES: 3190
96
TITLE: Aiming High versus Aiming All: Aquatic Toxicology and QSAR Multitarget Models. Aquatic Toxicology and QSAR Multitarget Models
AUTHORS: Moura, AS; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: Chemometrics and Cheminformatics in Aquatic Toxicology, PAGES: 167-179
AUTHORS: Moura, AS; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: Chemometrics and Cheminformatics in Aquatic Toxicology, PAGES: 167-179
INDEXED IN: Scopus CrossRef
Scopus CrossRef97
TITLE: AKT Inhibitors: The Road Ahead to Computational Modeling-Guided Discovery Full Text
AUTHORS: Halder, AK ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, VOLUME: 22, ISSUE: 8, PAGES: 3944
AUTHORS: Halder, AK ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, VOLUME: 22, ISSUE: 8, PAGES: 3944
98
TITLE: Chapter 11: Supported Vanadium Catalysts: Heterogeneous Molecular Complexes, Electrocatalysis and Biomass Transformation
AUTHORS: cristina freire ; Clara Pereira ; Jarrais, B; Fernandes, D ; Andreia F. Peixoto ; Cordeiro, N ; Teixeira, F ;
PUBLISHED: 2021, SOURCE: RSC Catalysis Series, VOLUME: 2021-January, ISSUE: 41, PAGES: 241-284
AUTHORS: cristina freire ; Clara Pereira ; Jarrais, B; Fernandes, D ; Andreia F. Peixoto ; Cordeiro, N ; Teixeira, F ;
PUBLISHED: 2021, SOURCE: RSC Catalysis Series, VOLUME: 2021-January, ISSUE: 41, PAGES: 241-284
99
TITLE: Chemistry edutainment: A storytelling activity for middle-school children. A Storytelling Activity for Middle-School Children
AUTHORS: José Ferraz-Caetano ; Dias, D;
PUBLISHED: 2021, SOURCE: Handbook of Research on Contemporary Storytelling Methods Across New Media and Disciplines, PAGES: 364-391
AUTHORS: José Ferraz-Caetano ; Dias, D;
PUBLISHED: 2021, SOURCE: Handbook of Research on Contemporary Storytelling Methods Across New Media and Disciplines, PAGES: 364-391
INDEXED IN: Scopus CrossRef
Scopus CrossRef100
TITLE: Chemometric Modeling of Daphnia Toxicity
AUTHORS: Halder, AK ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: Chemometrics and Cheminformatics in Aquatic Toxicology, PAGES: 293-317
AUTHORS: Halder, AK ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: Chemometrics and Cheminformatics in Aquatic Toxicology, PAGES: 293-317
INDEXED IN: Scopus CrossRef
Scopus CrossRef